3-dodecoxycarbonylphthalic acid

Systemtic Name: 3-dodecoxycarbonylphthalic acid Openeye Name: 3-dodecoxycarbonylphthalic acid CAS Name: 3-[dodecoxy(oxo)methyl]phthalic acid IUPAC Name: 3-dodecoxycarbonylphthalic acid Traditional Name: 3-lauryloxycarbonylphthalic acid Formula: C21H30O6 MolecularWeight: 378.4593

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC=CC(=C1C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC=CC(=C1C(=O)O)C(=O)O

InChI

InChI=1S/C21H30O6/c1-2-3-4-5-6-7-8-9-10-11-15-27-21(26)17-14-12-13-16(19(22)23)18(17)20(24)25/h12-14H,2-11,15H2,1H3,(H,22,23)(H,24,25)